Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
4-(Trifluoromethyl)benzamidine hydrochloride |
EINECS | N/A |
CAS No. | 38980-96-0 | Density | 1.46g/cm3 |
PSA | 49.87000 | LogP | 3.59150 |
Solubility | N/A | Melting Point |
158-161 °C |
Formula | C8H8ClF3N2 | Boiling Point | 253.2 °C at 760 mmHg |
Molecular Weight | 224.613 | Flash Point | 106.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Benzenecarboximidamide,4-(trifluoromethyl)-, monohydrochloride (9CI);4-(Trifluoromethyl)benzamidinehydrochloride;4-(Trifluoromethyl)phenylamidine hydrochloride;p-(Trifluoromethyl)benzamidine hydrochloride;a,a,a-Trifluoro-p-toluamidinehydrochloride;benzenecarboximidamide, 4-(trifluoromethyl)-, hydrochloride (1:1);4-(Trifluoromethyl)benzenecarboximidamide hydrochloride (1:1);4-(Trifluoromethyl)benzamidine HCl;4-(trifluoromethyl)benzene-1-carboximidamide hydrochloride; |
Article Data | 7 |
The Benzenecarboximidamide,4-(trifluoromethyl)-, hydrochloride (1:1), with the CAS registry number 38980-96-0, is also known as 4-(Trifluoromethyl)benzamidine hydrochloride. It belongs to the product category of pharmacetical. This chemical's molecular formula is C8H8ClF3N2 and molecular weight is 224.61. What's more, its systematic name is 4-(trifluoromethyl)benzenecarboximidamide hydrochloride (1:1).
Physical properties of Benzenecarboximidamide,4-(trifluoromethyl)-, hydrochloride (1:1) are: (1)ACD/LogP: 1.62; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 2; (6)ACD/KOC (pH 7.4): 2; (7)#H bond acceptors: 2; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 49.87 Å2; (11)Flash Point: 106.9 °C; (12)Enthalpy of Vaporization: 50.05 kJ/mol; (13)Boiling Point: 253.2 °C at 760 mmHg; (14)Vapour Pressure: 0.0146 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: Cl.FC(F)(F)c1ccc(cc1)C(N)=N
(2)InChI: InChI=1/C8H7F3N2.ClH/c9-8(10,11)6-3-1-5(2-4-6)7(12)13;/h1-4H,(H3,12,13);1H
(3)InChIKey: DKIFMADLURULQV-UHFFFAOYAM